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3,3,4,4(2H,5H)-Furantetracarbonitrile, 2-(4-methoxyphenyl)-5-(4-methylphenyl)-, cis-
SpectraBase Compound ID 32SJKAyL8VI
InChI InChI=1S/C22H16N4O2/c1-15-3-5-16(6-4-15)19-21(11-23,12-24)22(13-25,14-26)20(28-19)17-7-9-18(27-2)10-8-17/h3-10,19-20H,1-2H3/t19-,20+/m0/s1
InChIKey QMCGRMCNFNNBQY-VQTJNVASSA-N
Mol Weight 368.4 g/mol
Molecular Formula C22H16N4O2
Exact Mass 368.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Oyi6dc5hHd
Name 3,3,4,4(2H,5H)-Furantetracarbonitrile, 2-(4-methoxyphenyl)-5-(4-methylphenyl)-, cis-
CAS Registry Number 107245-99-8
Comments Less than 3 mono-isotopic peaks
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Formula C22H16N4O2
InChI InChI=1S/C22H16N4O2/c1-15-3-5-16(6-4-15)19-21(11-23,12-24)22(13-25,14-26)20(28-19)17-7-9-18(27-2)10-8-17/h3-10,19-20H,1-2H3/t19-,20+/m0/s1
InChIKey QMCGRMCNFNNBQY-VQTJNVASSA-N
Molecular Weight 368.396 g/mol
SMILES C1(C([C@](c2ccc(cc2)C)(O[C@@]1(c1ccc(cc1)OC)[H])[H])(C#N)C#N)(C#N)C#N
SPLASH splash10-0006-0090000000-9f65786a54ab056fc2f0
Source of Spectrum C-109-2787-14
Synonyms (2R,5S)-2-(4-methoxyphenyl)-5-(4-methylphenyl)-3,3,4,4(2H,5H)-furantetracarbonitrile
Wiley ID 1353183